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CL(18:0/18:0/16:1(9Z)/18:1(11Z))

Properties

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Occurences in reactions

MNX_ID

MNXM121723

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₇₉H₁₅₀O₁₇P₂

charge

mass

1433.03483

reference

hmdb:HMDB0056972

InChIKey

ASITWFRTSSIVBV-HOVAKLLUSA-N

InChI

InChI=1S/C79H150O17P2/c1-5-9-13-17-21-25-29-33-36-40-44-48-52-56-60-64-77(82)90-70-75(96-79(84)66-62-58-54-50-46-42-38-35-31-27-23-19-15-11-7-3)72-94-98(87,88)92-68-73(80)67-91-97(85,86)93-71-74(69-89-76(81)63-59-55-51-47-43-39-32-28-24-20-16-12-8-4)95-78(83)65-61-57-53-49-45-41-37-34-30-26-22-18-14-10-6-2/h26,28,30,32,73-75,80H,5-25,27,29,31,33-72H2,1-4H3,(H,85,86)(H,87,88)/b30-26-,32-28-/t73-,74-,75-/m1/s1

SMILES

CCCCCC/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCC)COP(=O)(O)OC[C@@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0056972	CL(18:0/18:0/16:1(9Z)/18:1(11Z)) (2S)-3-{[(2R)-2,3-bis(octadecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy((2R)-3-[(9Z)-hexadec-9-enoyloxy]-2-[(11Z)-octadec-11-enoyloxy]propoxy)phosphinic acid 1'-[1,2-Dioctadecanoyl-rac-glycero-3-phospho],3'-[1,2-di(9Z-hexadecenoyl)-rac-glycero-3-phospho]-glycerol 1'-[1,2-Distearoyl-rac-glycero-3-phospho],3'-[1,2-dipalmitoleoyl-rac-glycero-3-phospho]-glycerol CL(1'-[18:0/18:0],3'-[16:1(9Z)/16:1(9Z)]) CL(18:0/18:0/16:1/16:1) CL(68:2) Cardiolipin(18:0/18:0/16:1/16:1) Cardiolipin(68:2) [(2S)-3-({[(2R)-2,3-bis(octadecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-[(9Z)-hexadec-9-enoyloxy]-2-[(11Z)-octadec-11-enoyloxy]propoxy]phosphinic acid
SLM:000517619 slm:000517619	Cardiolipin (18:0/18:0/16:1(9Z)/18:1(11Z)) 1'-[1,2-di-octadecanoyl-sn-glycero-3-phospho],3'-[1-(9Z-hexadecenoyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phospho]-glycerol CL (18:0/18:0/16:1(9Z)/18:1(11Z))
hmdb:HMDB56972	secondary/obsolete/fantasy identifier